BindingDB logo
myBDB logout

BDBM50243242 ((2S,4S)-4-(benzylamino)pyrrolidin-2-yl)(isoindolin-2-yl)methanone::CHEMBL486049

SMILES: O=C([C@@H]1C[C@@H](CN1)NCc1ccccc1)N1Cc2ccccc2C1

InChI Key: InChIKey=BCZDZAZLTVKVSQ-OALUTQOASA-N

Data: 4 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50243242   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Dipeptidyl peptidase 2 (DPP II)


(Homo sapiens (Human))
BDBM50243242
PNG
(((2S,4S)-4-(benzylamino)pyrrolidin-2-yl)(isoindoli...)
Show SMILES O=C([C@@H]1C[C@@H](CN1)NCc1ccccc1)N1Cc2ccccc2C1
Show InChI InChI=1S/C20H23N3O/c24-20(23-13-16-8-4-5-9-17(16)14-23)19-10-18(12-22-19)21-11-15-6-2-1-3-7-15/h1-9,18-19,21-22H,10-14H2/t18-,19-/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 3.40E+3n/an/an/an/an/an/a



University of Antwerp

Curated by ChEMBL


Assay Description
Inhibition of DPP2 (unknown origin)


Bioorg Med Chem Lett 18: 4159-62 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.079
BindingDB Entry DOI: 10.7270/Q2KS6RC4
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 9


(Homo sapiens (Human))
BDBM50243242
PNG
(((2S,4S)-4-(benzylamino)pyrrolidin-2-yl)(isoindoli...)
Show SMILES O=C([C@@H]1C[C@@H](CN1)NCc1ccccc1)N1Cc2ccccc2C1
Show InChI InChI=1S/C20H23N3O/c24-20(23-13-16-8-4-5-9-17(16)14-23)19-10-18(12-22-19)21-11-15-6-2-1-3-7-15/h1-9,18-19,21-22H,10-14H2/t18-,19-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.31E+4n/an/an/an/an/an/a



University of Antwerp

Curated by ChEMBL


Assay Description
Inhibition of DPP9 (unknown origin)


Bioorg Med Chem Lett 18: 4159-62 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.079
BindingDB Entry DOI: 10.7270/Q2KS6RC4
More data for this
Ligand-Target Pair
Dipeptidyl peptidase VIII


(Homo sapiens (Human))
BDBM50243242
PNG
(((2S,4S)-4-(benzylamino)pyrrolidin-2-yl)(isoindoli...)
Show SMILES O=C([C@@H]1C[C@@H](CN1)NCc1ccccc1)N1Cc2ccccc2C1
Show InChI InChI=1S/C20H23N3O/c24-20(23-13-16-8-4-5-9-17(16)14-23)19-10-18(12-22-19)21-11-15-6-2-1-3-7-15/h1-9,18-19,21-22H,10-14H2/t18-,19-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 2.90E+3n/an/an/an/an/an/a



University of Antwerp

Curated by ChEMBL


Assay Description
Inhibition of DPP8 (unknown origin)


Bioorg Med Chem Lett 18: 4159-62 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.079
BindingDB Entry DOI: 10.7270/Q2KS6RC4
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50243242
PNG
(((2S,4S)-4-(benzylamino)pyrrolidin-2-yl)(isoindoli...)
Show SMILES O=C([C@@H]1C[C@@H](CN1)NCc1ccccc1)N1Cc2ccccc2C1
Show InChI InChI=1S/C20H23N3O/c24-20(23-13-16-8-4-5-9-17(16)14-23)19-10-18(12-22-19)21-11-15-6-2-1-3-7-15/h1-9,18-19,21-22H,10-14H2/t18-,19-/m0/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>2.50E+5n/an/an/an/an/an/a



University of Antwerp

Curated by ChEMBL


Assay Description
Inhibition of DPP4 (unknown origin)


Bioorg Med Chem Lett 18: 4159-62 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.079
BindingDB Entry DOI: 10.7270/Q2KS6RC4
More data for this
Ligand-Target Pair